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1H-purine-7-acetic acid, 2,3,6,7-tetrahydro-1,3-dimethyl-2,6-dioxo-, 2-[(E)-(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]hydrazide
SpectraBase Compound ID DOU8D4jdCqq
InChI InChI=1S/C17H17BrN6O5/c1-22-15-13(16(27)23(2)17(22)28)24(8-19-15)7-12(25)21-20-6-9-4-10(18)14(26)11(5-9)29-3/h4-6,8,26H,7H2,1-3H3,(H,21,25)/b20-6+
InChIKey CJUCJJZRLWWYES-CGOBSMCZSA-N
Mol Weight 465.26 g/mol
Molecular Formula C17H17BrN6O5
Exact Mass 464.044381 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID PtYgqUBvog
Name 1H-purine-7-acetic acid, 2,3,6,7-tetrahydro-1,3-dimethyl-2,6-dioxo-, 2-[(E)-(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]hydrazide
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C17H17BrN6O5/c1-22-15-13(16(27)23(2)17(22)28)24(8-19-15)7-12(25)21-20-6-9-4-10(18)14(26)11(5-9)29-3/h4-6,8,26H,7H2,1-3H3,(H,21,25)/b20-6+
InChIKey CJUCJJZRLWWYES-CGOBSMCZSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_5032
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: NMR/10248708